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921755-07-9

921755-07-9 | 2-Undecenoic acid, 4-oxo-3-(phenylseleno)-2-propyl-, ethyl ester, (2E)-

CAS No: 921755-07-9 Catalog No: AG006GPZ MDL No:

Product Description

Catalog Number:
AG006GPZ
Chemical Name:
2-Undecenoic acid, 4-oxo-3-(phenylseleno)-2-propyl-, ethyl ester, (2E)-
CAS Number:
921755-07-9
Molecular Formula:
C22H32O3Se
Molecular Weight:
423.4477
IUPAC Name:
ethyl 4-oxo-3-phenylselanyl-2-propylundec-2-enoate
InChI:
InChI=1S/C22H32O3Se/c1-4-7-8-9-13-17-20(23)21(26-18-15-11-10-12-16-18)19(14-5-2)22(24)25-6-3/h10-12,15-16H,4-9,13-14,17H2,1-3H3
InChI Key:
FFQCSWGOWOULHB-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)/C(=C(\C(=O)OCC)/CCC)/[Se]c1ccccc1

Properties

Complexity:
450  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
424.152g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
423.466g/mol
Monoisotopic Mass:
424.152g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  

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